1-(3-Methoxybenzyl)-1H-indole-3-carbaldehyde - CAS 261637-72-3
Catalog: |
BB047158 |
Product Name: |
1-(3-Methoxybenzyl)-1H-indole-3-carbaldehyde |
CAS: |
261637-72-3 |
Synonyms: |
1H-Indole-3-carboxaldehyde, 1-[(3-methoxyphenyl)methyl]- |
IUPAC Name: | 1-[(3-methoxyphenyl)methyl]indole-3-carbaldehyde |
Description: | 1-(3-Methoxybenzyl)-1H-indole-3-carbaldehyde (CAS# 261637-72-3 ) is a useful research chemical. |
Molecular Weight: | 265.31 |
Molecular Formula: | C17H15NO2 |
Canonical SMILES: | COC1=CC=CC(=C1)CN2C=C(C3=CC=CC=C32)C=O |
InChI: | InChI=1S/C17H15NO2/c1-20-15-6-4-5-13(9-15)10-18-11-14(12-19)16-7-2-3-8-17(16)18/h2-9,11-12H,10H2,1H3 |
InChI Key: | LUHVNBQTVLWMTH-UHFFFAOYSA-N |
Boiling Point: | 473.8 °C at 760 mmHg |
Density: | 1.13 g/cm3 |
Complexity: | 333 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 265.110278721 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 265.110278721 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 31.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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